1 LAMMPS Description 2 3 45 atoms 4 5 3 atom types 6 7 0.0000000000000000 17.202999999999999 xlo xhi 8 0.0000000000000000 18.009000000000000 ylo yhi 9 0.0000000000000000 21.643000000000001 zlo zhi 10 11 Masses 12 13 1 15.9994 14 2 12.01 15 3 1.0079 16 17 Atoms 18 19 1 1 1 0.0 8.62700 8.66700 12.48600 20 2 1 1 0.0 9.11200 9.11800 10.27300 21 3 1 1 0.0 8.45700 11.33100 10.49000 22 4 1 1 0.0 11.72600 8.36500 10.66700 23 5 1 1 0.0 8.06500 8.99400 7.93600 24 6 1 2 0.0 9.62800 9.07200 11.59100 25 7 1 3 0.0 9.90900 10.08300 11.89200 26 8 1 2 0.0 9.07000 10.40400 9.64000 27 9 1 1 0.0 6.14600 11.61000 8.00500 28 10 1 1 0.0 11.07200 10.13000 8.37600 29 11 1 1 0.0 6.10200 10.00900 11.62100 30 12 1 2 0.0 8.14000 10.29100 8.45100 31 13 1 3 0.0 8.49000 10.91200 7.62300 32 14 1 1 0.0 7.41500 7.08400 14.43400 33 15 1 2 0.0 10.75100 8.07000 11.65100 34 16 1 3 0.0 11.24000 8.11800 12.63400 35 17 1 2 0.0 7.09000 11.63400 10.17000 36 18 1 3 0.0 7.06900 12.69800 9.91100 37 19 1 2 0.0 7.97200 7.44200 12.14000 38 20 1 3 0.0 7.54700 7.58300 11.13800 39 21 1 1 0.0 11.24900 5.73000 11.78600 40 22 1 2 0.0 10.26800 6.65900 11.37300 41 23 1 3 0.0 10.12300 6.53400 10.29200 42 24 1 2 0.0 6.78400 10.79500 8.95500 43 25 1 3 0.0 6.12100 9.95500 9.19600 44 26 1 2 0.0 10.47500 10.88300 9.39800 45 27 1 3 0.0 10.49500 11.92100 9.06900 46 28 1 3 0.0 11.09100 10.82000 10.30900 47 29 1 2 0.0 8.99100 6.32000 12.11700 48 30 1 3 0.0 9.23100 6.01100 13.14400 49 31 1 2 0.0 6.86600 7.25300 13.14500 50 32 1 3 0.0 6.17700 8.10100 13.15700 51 33 1 3 0.0 6.28900 6.35300 12.94300 52 34 1 2 0.0 6.24000 11.39400 11.39300 53 35 1 3 0.0 6.66500 11.86500 12.28300 54 36 1 3 0.0 5.23100 11.78100 11.26000 55 37 1 1 0.0 8.34300 5.24100 11.48000 56 38 1 3 0.0 12.00100 9.28600 10.78200 57 39 1 3 0.0 12.06300 5.97500 11.33000 58 40 1 3 0.0 6.99600 9.67600 11.79700 59 41 1 3 0.0 7.93700 7.87600 14.60900 60 42 1 3 0.0 10.95500 9.19800 8.60700 61 43 1 3 0.0 5.94400 11.05900 7.24100 62 44 1 3 0.0 7.94900 8.39500 8.68400 63 45 1 3 0.0 8.96400 4.50300 11.48800 64